[WIP] Fix multi chain RMSD analysis #64
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hannahbaumann
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Check if this works for triclinic boxes. From Irfan: There might also be code in MDAnalysis that does the math also working for triclinic boxes. |
hannahbaumann
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Jan 26, 2026
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| @pytest.fixture(scope="session") | ||
| def simulation_nc_multichain() -> pathlib.Path: | ||
| return "data/simulation.nc" |
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Will put this on permanent storage / swap with the skipped dataset.
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